(1s 2 2s 1 ) 2 S Ar 15+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 2020.
N.V.Novikov // Wave Function Value Database;
http://cdfe.sinp.msu.ru/services/wftables/
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 15.319239 | .40981148 |
| 2 | 2s | 7.734118 | -.68620610 |
| 3 | 3s | 9.783687 | -.41426822 |
| 4 | 5s | 18.404492 | -.01451845 |
| 5 | 4s | 36.116128 | .00078865 |
| 6 | 5s | 68.466195 | -.00003662 |
| 7 | 5s | 5.948434 | .00039426 |
| ORB.ENERGY,a.u. | -33.747000 | ||
| NORM | 1.000000 | < R > | .358410 | < R2 > | .149804 | < 1/R > | 4.127858 | < 1/R**2 > | 68.594794 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 17.365277 | .94077216 |
| 2 | 1s | 27.661918 | .04691969 |
| 3 | 2s | 22.029818 | .01726732 |
| 4 | 3s | 11.117166 | .00091823 |
| 5 | 4s | 32.483959 | -.00086041 |
| 6 | 5s | 43.353663 | .00033089 |
| 7 | 3s | 47.140067 | -.00044117 |
| ORB.ENERGY,a.u. | -147.810000 |
| NORM | 1.000000 | < R > | .085201 | < R2 > | .009710 | < 1/R > | 17.674597 | < 1/R**2 > | 627.880149 |
Total Energy= -346.44649086 a.u.
Kinetic Energy= 346.44649291 a.u.
Potential Energy= -692.89298377 a.u.
Virial Ratio = -1.99999999